SCHEMBL8700258

SCHEMBL8700258

O=C(O)[C@H](Cc1ccccc1)Nc1nc2ccccc2c(=O)o1

nearest known ligand 0.82

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ELANE P08246 18/20 0.82

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8702543 1.00 ELANE (0.82) ELANE
SCHEMBL10362665 0.90 ELANE (1.00) ELANE
SCHEMBL8698628 0.87 ELANE (0.64) ELANE
SCHEMBL10363034 0.86 ELANE (1.00) ELANE
SCHEMBL10364290 0.84 ELANE (0.80) ELANE
SCHEMBL6499915 0.83 ELANE (0.62) ELANE
SCHEMBL27493723 0.83 ELANE (0.62) ELANE
SCHEMBL8699698 0.83 ELANE (0.59) ELANE
SCHEMBL10362672 0.83 ELANE (0.87) ELANE
SCHEMBL6500714 0.79 ELANE (0.58) ELANE

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998033783-A1 SOLID PHASE AND COMBINATORIAL LIBRARY SYNTHESES OF 3,1-BENZOXAZINE-4-ONES VERSICOR, INC. (US) 1998-08-06 WO disclosed